| ## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
| Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
| 1 |
1 |
|
D |
88 |
15 |
2732 |
◊ |
B |
x,y,z |
1_555 |
112 |
35 |
5326 |
939.3 |
-12.3 |
0.213 |
16 |
3 |
0 |
0.321 |
2 |
|
C |
93 |
15 |
2689 |
◊ |
A |
x,y,z |
1_555 |
108 |
33 |
5420 |
917.6 |
-13.0 |
0.178 |
11 |
2 |
0 |
0.321 |
| Average: |
928.5 |
-12.7 |
0.195 |
14 |
3 |
0 |
0.321 |
| 2 |
3 |
|
A |
31 |
6 |
5420 |
◊ |
C |
-x+1/2,-y,z-1/2 |
2_554 |
27 |
7 |
2689 |
269.2 |
0.7 |
0.751 |
2 |
0 |
0 |
0.002 |
| 3 |
4 |
|
B |
39 |
12 |
5326 |
◊ |
A |
x,y,z |
1_555 |
28 |
9 |
5420 |
265.5 |
3.7 |
0.888 |
4 |
2 |
0 |
0.000 |
| 4 |
5 |
|
B |
30 |
12 |
5326 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
30 |
12 |
5420 |
263.9 |
-6.4 |
0.034 |
4 |
0 |
0 |
0.041 |
| 5 |
6 |
|
A |
25 |
7 |
5420 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
30 |
8 |
5326 |
231.8 |
-1.3 |
0.372 |
3 |
4 |
0 |
0.033 |
| 6 |
7 |
|
D |
20 |
4 |
2732 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
24 |
8 |
5420 |
226.2 |
-2.2 |
0.407 |
3 |
2 |
0 |
0.075 |
8 |
|
B |
21 |
8 |
5326 |
◊ |
C |
-x+1/2,-y,z-1/2 |
2_554 |
20 |
4 |
2689 |
205.9 |
-2.2 |
0.378 |
4 |
2 |
0 |
0.075 |
| Average: |
216.1 |
-2.2 |
0.393 |
4 |
2 |
0 |
0.075 |
| 7 |
9 |
|
D |
19 |
4 |
2732 |
◊ |
B |
-x+1,y-1/2,-z-1/2 |
3_644 |
20 |
5 |
5326 |
179.4 |
-0.5 |
0.495 |
1 |
1 |
0 |
0.000 |
| 8 |
10 |
|
A |
23 |
7 |
5420 |
◊ |
C |
-x,y-1/2,-z-1/2 |
3_544 |
14 |
3 |
2689 |
170.1 |
-3.5 |
0.233 |
2 |
2 |
0 |
0.000 |
| 9 |
11 |
|
A |
25 |
7 |
5420 |
◊ |
B |
x-1,y,z |
1_455 |
20 |
7 |
5326 |
164.7 |
0.6 |
0.640 |
0 |
2 |
0 |
0.000 |
| 10 |
12 |
|
C |
18 |
4 |
2689 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
15 |
6 |
5326 |
158.3 |
1.9 |
0.817 |
0 |
0 |
0 |
0.000 |
| 11 |
13 |
|
D |
17 |
4 |
2732 |
◊ |
B |
-x+3/2,-y,z-1/2 |
2_654 |
12 |
4 |
5326 |
146.9 |
-0.8 |
0.571 |
3 |
0 |
0 |
0.000 |
| 12 |
14 |
|
A |
16 |
6 |
5420 |
x |
A |
-x,y-1/2,-z-1/2 |
3_544 |
17 |
7 |
5420 |
141.4 |
-0.1 |
0.588 |
3 |
0 |
0 |
0.000 |
| 13 |
15 |
|
A |
9 |
4 |
5420 |
◊ |
D |
x-1/2,-y-1/2,-z |
4_445 |
14 |
4 |
2732 |
101.4 |
-1.5 |
0.283 |
0 |
0 |
0 |
0.000 |
| 14 |
16 |
|
A |
10 |
4 |
5420 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
11 |
3 |
5326 |
92.5 |
-0.2 |
0.579 |
1 |
0 |
0 |
0.000 |
| 15 |
17 |
|
A |
9 |
4 |
5420 |
◊ |
B |
-x+1,y-1/2,-z-1/2 |
3_644 |
8 |
2 |
5326 |
84.3 |
0.6 |
0.740 |
2 |
0 |
0 |
0.000 |
| 16 |
18 |
|
B |
13 |
5 |
5326 |
x |
B |
-x+1,y-1/2,-z-1/2 |
3_644 |
8 |
4 |
5326 |
81.1 |
1.8 |
0.853 |
0 |
0 |
0 |
0.000 |
| 17 |
19 |
|
A |
7 |
3 |
5420 |
◊ |
D |
-x+1,y-1/2,-z-1/2 |
3_644 |
5 |
1 |
2732 |
62.0 |
0.8 |
0.709 |
1 |
0 |
0 |
0.000 |
| 18 |
20 |
|
C |
5 |
2 |
2689 |
◊ |
B |
x-1,y,z |
1_455 |
4 |
2 |
5326 |
54.3 |
1.3 |
0.841 |
1 |
0 |
0 |
0.000 |
| 19 |
21 |
|
[ZN]A:103 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
5420 |
48.9 |
-29.7 |
0.000 |
0 |
0 |
0 |
0.413 |
| 20 |
22 |
|
[ZN]B:102 |
1 |
1 |
98 |
cf |
B |
x,y,z |
1_555 |
9 |
4 |
5326 |
41.3 |
-24.6 |
0.000 |
0 |
0 |
0 |
0.431 |
| 21 |
23 |
|
[ZN]A:101 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
5420 |
40.8 |
-25.1 |
0.000 |
0 |
0 |
0 |
0.321 |
24 |
|
[ZN]B:101 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
5326 |
31.8 |
-18.3 |
0.000 |
0 |
0 |
0 |
0.321 |
| Average: |
36.3 |
-21.7 |
0.000 |
0 |
0 |
0 |
0.321 |
| 22 |
25 |
|
[ZN]A:102 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
5420 |
39.3 |
-21.7 |
0.000 |
0 |
0 |
0 |
0.302 |
| 23 |
26 |
|
C |
6 |
3 |
2689 |
◊ |
B |
x,y,z |
1_555 |
8 |
3 |
5326 |
39.2 |
0.4 |
0.661 |
0 |
0 |
0 |
0.000 |
| 24 |
27 |
|
A |
8 |
2 |
5420 |
x |
A |
-x+1/2,-y,z-1/2 |
2_554 |
5 |
1 |
5420 |
37.9 |
0.4 |
0.718 |
0 |
0 |
0 |
0.000 |
| 25 |
28 |
|
B |
6 |
2 |
5326 |
x |
B |
-x+3/2,-y,z-1/2 |
2_654 |
6 |
2 |
5326 |
37.1 |
0.8 |
0.774 |
0 |
0 |
0 |
0.000 |
| 26 |
29 |
|
D |
3 |
1 |
2732 |
cf |
[ZN]A:101 |
-x+1/2,-y,z-1/2 |
2_554 |
1 |
1 |
98 |
33.4 |
-13.7 |
0.000 |
0 |
0 |
0 |
0.221 |
30 |
|
[ZN]B:101 |
1 |
1 |
98 |
f |
C |
-x+1/2,-y,z-1/2 |
2_554 |
3 |
1 |
2689 |
25.2 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.221 |
| Average: |
29.3 |
-11.8 |
0.000 |
0 |
0 |
0 |
0.221 |
| 27 |
31 |
|
[ZN]A:102 |
1 |
1 |
98 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
7 |
3 |
5326 |
31.4 |
-17.8 |
0.000 |
0 |
0 |
0 |
0.183 |
| 28 |
32 |
|
[ZN]B:101 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
5420 |
27.8 |
-10.4 |
0.000 |
0 |
0 |
0 |
0.145 |
| 29 |
33 |
|
[ZN]B:102 |
1 |
1 |
98 |
◊ |
B |
-x+1,y-1/2,-z-1/2 |
3_644 |
4 |
2 |
5326 |
25.4 |
-10.3 |
0.000 |
0 |
0 |
0 |
0.000 |
| 30 |
34 |
|
A |
3 |
1 |
5420 |
◊ |
D |
x-1,y,z |
1_455 |
3 |
1 |
2732 |
24.0 |
0.2 |
0.674 |
0 |
0 |
0 |
0.000 |
| 31 |
35 |
|
C |
2 |
1 |
2689 |
◊ |
D |
x-1/2,-y-1/2,-z |
4_445 |
4 |
2 |
2732 |
21.4 |
-0.5 |
0.455 |
0 |
0 |
0 |
0.000 |
| 32 |
36 |
|
A |
4 |
1 |
5420 |
◊ |
D |
-x+1/2,-y,z-1/2 |
2_554 |
2 |
1 |
2732 |
21.4 |
-0.6 |
0.380 |
0 |
0 |
0 |
0.004 |
| 33 |
37 |
|
D |
3 |
1 |
2732 |
x |
D |
-x+1,y-1/2,-z-1/2 |
3_644 |
1 |
1 |
2732 |
20.5 |
-0.4 |
0.395 |
0 |
0 |
0 |
0.000 |
| 34 |
38 |
|
[ZN]A:103 |
1 |
1 |
98 |
◊ |
B |
-x+1,y-1/2,-z-1/2 |
3_644 |
1 |
1 |
5326 |
17.7 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.000 |
| 35 |
39 |
|
D |
2 |
1 |
2732 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
5420 |
14.8 |
0.8 |
0.880 |
0 |
0 |
0 |
0.000 |
| 36 |
40 |
|
[ZN]B:102 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
2732 |
11.2 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.062 |
| 37 |
41 |
|
A |
1 |
1 |
5420 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
5326 |
5.8 |
-0.0 |
0.521 |
0 |
0 |
0 |
0.000 |
|